1H-Pyrrole-1-acetic acid, 2-(4,5-bis(4-methoxyphenyl)-2-thiazolyl-, methyl ester
Basic information
- CAS
101001-33-6- Standard SMILES
COC(=O)Cn1cccc1-c1nc(-c2ccc(OC)cc2)c(-c2ccc(OC)cc2)s1- InChIKey
UPGJYJSMOOPNSM-UHFFFAOYSA-N- Molecular formula
- C24H22N2O4S
- Average molar mass
- 434.5 g/mol
- Monoisotopic mass
- 434.13002836
Names & identifiers
- Preferred name
- 1H-Pyrrole-1-acetic acid, 2-(4,5-bis(4-methoxyphenyl)-2-thiazolyl-, methyl ester
- IUPAC
- methyl 2-[2-[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]pyrrol-1-yl]acetate
Names & synonyms
101001-33-6Methyl-2-(4,5-bis(4-methoxyphenyl)thiazol-2-yl)-pyrrole-1-acetateMethyl 2-(4,5-bis(4-methoxyphenyl)-2-thiazolyl-1H-pyrrole-1-acetate)1H-Pyrrole-1-acetic acid, 2-(4,5-bis(4-methoxyphenyl)-2-thiazolyl-, methyl esterDTXSID30143631RefChem:240412DTXCID9066122SCHEMBL10505716Methyl {2-[4,5-bis(4-methoxyphenyl)-1,3-thiazol-2-yl]-1H-pyrrol-1-yl}acetate
Database identifiers
- CAS
101001-33-6- PubChem CID
- 3063473
- DTXSID
DTXSID30143631
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 90.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 578
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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